4-fluoro-N-piperidin-1-ylbenzamide

C12H15FN2O — CID 9270994

IUPAC4-fluoro-N-piperidin-1-ylbenzamide
SMILESO=C(NN1CCCCC1)c1ccc(F)cc1
InChIInChI=1S/C12H15FN2O/c13-11-6-4-10(5-7-11)12(16)14-15-8-2-1-3-9-15/h4-7H,1-3,8-9H2,(H,14,16)
InChIKeyWCRZYLXJXKAITN-UHFFFAOYSA-N
MW222.26 g/mol
LogP1.96
Rot. Bonds2

About 4-fluoro-N-piperidin-1-ylbenzamide

4-fluoro-N-piperidin-1-ylbenzamide (PubChem CID 9270994) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 4-fluoro-N-piperidin-1-ylbenzamide.

Molecular Properties

Compound Name4-fluoro-N-piperidin-1-ylbenzamide
PubChem CID9270994
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name4-fluoro-N-piperidin-1-ylbenzamide
SMILESO=C(NN1CCCCC1)c1ccc(F)cc1
InChIInChI=1S/C12H15FN2O/c13-11-6-4-10(5-7-11)12(16)14-15-8-2-1-3-9-15/h4-7H,1-3,8-9H2,(H,14,16)
InChIKeyWCRZYLXJXKAITN-UHFFFAOYSA-N
XLogP1.96
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-piperidin-1-ylbenzamide?
The IUPAC name of 4-fluoro-N-piperidin-1-ylbenzamide (CID 9270994) is 4-fluoro-N-piperidin-1-ylbenzamide.
What is the SMILES notation for 4-fluoro-N-piperidin-1-ylbenzamide?
The canonical SMILES for 4-fluoro-N-piperidin-1-ylbenzamide is O=C(NN1CCCCC1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-piperidin-1-ylbenzamide?
The InChIKey is WCRZYLXJXKAITN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c13-11-6-4-10(5-7-11)12(16)14-15-8-2-1-3-9-15/h4-7H,1-3,8-9H2,(H,14,16).
What are the key properties of 4-fluoro-N-piperidin-1-ylbenzamide?
4-fluoro-N-piperidin-1-ylbenzamide has a molecular weight of 222.26 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-piperidin-1-ylbenzamide is sourced from PubChem (CID 9270994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).